Vitas-M small molecule compound

dipropan-2-yl 5-({[6-bromo-2-(4-methylphenyl)quinolin-4-yl]carbonyl}amino)benzene-1,3-dicarboxylate

Catalog ID
STK429820
SMILES CC(OC(=O)c1cc(cc(c1)C(=O)OC(C)C)NC(=O)c1cc(nc2c1cc(Br)cc2)c1ccc(cc1)C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C31H29BrN2O5 MW 589.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29BrN2O5/c1-17(2)38-30(36)21-12-22(31(37)39-18(3)4)14-24(13-21)33-29(35)26-16-28(20-8-6-19(5)7-9-20)34-27-11-10-23(32)15-25(26)27/h6-18H,1-5H3,(H,33,35)
InChIKey
YXSBGQCTPRPJNC-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC(=CC(=C4)C(=O)OC(C)C)C(=O)OC(C)C
DIISOPROPYL5(((6BROMO2(4METHYLPHENYL)4QUINOLINYL)CARBONYL)AMINO)ISOPHTHALATE
dipropan2yl5(((6bromo2(4methylphenyl)quinolin4yl)carbonyl)amino)benzene13dicarboxylate
DIPROPAN2YL5((6BROMO2(4METHYLPHENYL)QUINOLINE4CARBONYL)AMINO)BENZENE13DICARBOXYLATE
InChI=1SC31H29BrN2O5c117(2)3830(36)211222(31(37)3918(3)4)1424(1321)3329(35)261628(208619(5)7920)3427111023(32)1525(26)27h618H15H3(H3335)
METHYLETHYL5((6BROMO2(4METHYLPHENYL)(4QUINOLYL))CARBONYLAMINO)3((METHYLETHYL)OXYCARBONYL)BENZOATE
MFCD03233478
ZINC000002105129
ZINC02105129
ZINC2105129

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Available files

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